CID 82623635

Tert-butyl 3-(1-amino-2-hydroxypropan-2-yl)piperidine-1-carboxylate

Structural Information

Molecular Formula
C13H26N2O3
SMILES
CC(C)(C)OC(=O)N1CCCC(C1)C(C)(CN)O
InChI
InChI=1S/C13H26N2O3/c1-12(2,3)18-11(16)15-7-5-6-10(8-15)13(4,17)9-14/h10,17H,5-9,14H2,1-4H3
InChIKey
JIBIFMUBOQYMBV-UHFFFAOYSA-N
Compound name
tert-butyl 3-(1-amino-2-hydroxypropan-2-yl)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.19434 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.20162 162.0
[M+Na]+ 281.18356 168.0
[M+NH4]+ 276.22816 166.9
[M+K]+ 297.15750 166.0
[M-H]- 257.18706 160.1
[M+Na-2H]- 279.16901 163.1
[M]+ 258.19379 161.9
[M]- 258.19489 161.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.